SCHEMBL472460

SCHEMBL472460

Cc1cc(Cl)ccc1-c1ocnc1C

nearest known ligand 0.53

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
NOTUM Q6P988 2/20 0.53
HSD17B10 Q99714 4/20 0.43
ALDH1A1 P00352 3/20 0.43
LMNA P02545 3/20 0.43
POLB P06746 3/20 0.40
NPC1 O15118 2/20 0.40
RAB9A P51151 2/20 0.40
TSHR P16473 1/20 0.40
IMPDH2 P12268 2/20 0.39
IMPDH1 P20839 1/20 0.39
SMN1; SMN2 Q16637 1/20 0.38
ESR1 P03372 1/20 0.37
ESR2 Q92731 1/20 0.37
CASP3 P42574 1/20 0.37
BDKRB2 P30411 1/20 0.36
MAPK14 Q16539 2/20 0.36
HSP90AB1 P08238 1/20 0.35
HSD11B1 P28845 1/20 0.35
CRHR1 P34998 1/20 0.35
GRM1 Q13255 1/20 0.34

Click a target to see other patent compounds predicted against it — the reverse direction, in place.

Similar compounds — the chemically nearest patent molecules

Nearest neighbours by Morgan-fingerprint cosine across the patent-compound collection, with each neighbour's top predicted target and the predicted targets it shares with this molecule.

Compoundsimilaritytop predictedshared targets
SCHEMBL472411 0.74 GAA (0.49) NOTUMHSD17B10ALDH1A1LMNAPOLB
SCHEMBL12071484 0.72 NOTUM (0.50) NOTUMLMNAPOLBCASP3HSP90AB1
SCHEMBL472399 0.72 NOTUM (0.45) NOTUMALDH1A1LMNAPOLBNPC1
SCHEMBL9953638 0.72 NOTUM (0.47) NOTUMHSD17B10ALDH1A1LMNAPOLB
SCHEMBL29719717 0.72 NOTUM (0.53) NOTUMPOLBCASP3HSD11B1
SCHEMBL12693194 0.71 NOTUM (0.44) NOTUMHSD17B10ALDH1A1LMNAPOLB
SCHEMBL8021753 0.70 IMPDH2 (0.39) ALDH1A1NPC1RAB9AIMPDH2IMPDH1
SCHEMBL23451556 0.69 NOTUM (1.00) NOTUMALDH1A1LMNANPC1RAB9A
SCHEMBL13393503 0.69 IMPDH2 (0.38) IMPDH2IMPDH1MAPK14
SCHEMBL30412729 0.69 NOTUM (1.00) NOTUMALDH1A1LMNANPC1RAB9A

Similarity is cosine over the 2,048-bit Morgan fingerprint (≈ Tanimoto). Identical fingerprints score 1.00.

Patent provenance — the patents this molecule appears in, and who filed them

Claimed or disclosed in 6 patents. claimed = in the patent's claims; disclosed = body only.

PatentTitleAssigneePublishedPriorityFilingCountryStatus
EP-2412372-A1 2-Aminooxazole derivatives for use as TRPV1 antagonists for treating i.a. pain, inflammation, neurodegenerative diseases or gastrointestinal diseases Abbott Laboratories (US) 2012-02-01 EP disclosed
US-7998993-B2 TRPV1 antagonists ABBOTT LABORATORIES (US) 2011-08-16 US disclosed
EP-2220059-B1 2-AMINOOXAZOLE DERIVATIVES AS TRPVL ANTAGONISTS USEFUL FOR TREATING PAIN ABBOTT LAB (US) 2011-08-03 EP disclosed
EP-2220059-A1 2-AMINOOXAZOLE DERIVATIVES AS TRPVL ANTAGONISTS USEFUL FOR TREATING PAIN Abbott Laboratories (US) 2010-08-25 EP disclosed
US-20090124666-A1 TRPV1 ANTAGONISTS ABBOTT LABORATORIES (US) 2009-05-14 US disclosed
WO-2009055749-A1 2-AMINOOXAZOLE DERIVATIVES AS TRPVL ANTAGONISTS USEFUL FOR TREATING PAIN ABBOTT LABORATORIES (US) 2009-04-30 WO disclosed

Patent text — is the patent's own abstract consistent with the prediction?

For each of this compound's patents that has machine-readable text (1 of them — usually the abstract, not the full specification), we ask MedCPT which protein the text reads most about, and where the chemistry-predicted target lands among 4885 human targets. A high rank means the patent's own wording is consistent with the prediction — a weak, independent signal, not proof of activity.

PatentTitleText reads most aboutPredicted target · text-rank
US-20090124666-A1 TRPV1 ANTAGONISTS TRPV1, TRPV2, TRPV3 NOTUM 3762/4885HSD17B10 3745/4885ALDH1A1 2031/4885

“Text reads most about” is the patent abstract's nearest protein in MedCPT space (background-debiased). Only ~1.4% of patents have machine-readable text, so most compounds won't have this panel.